8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one

C11H17N3O — CID 153405165

IUPAC8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one
SMILESCCC(C)N1CCn2c(nccc2=O)C1
InChIInChI=1S/C11H17N3O/c1-3-9(2)13-6-7-14-10(8-13)12-5-4-11(14)15/h4-5,9H,3,6-8H2,1-2H3
InChIKeyUCLMJPWIQPTZFF-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.86
Rot. Bonds2

About 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one

8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one (PubChem CID 153405165) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one.

Molecular Properties

Compound Name8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one
PubChem CID153405165
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one
SMILESCCC(C)N1CCn2c(nccc2=O)C1
InChIInChI=1S/C11H17N3O/c1-3-9(2)13-6-7-14-10(8-13)12-5-4-11(14)15/h4-5,9H,3,6-8H2,1-2H3
InChIKeyUCLMJPWIQPTZFF-UHFFFAOYSA-N
XLogP0.86
TPSA38.13 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6,7,8,9-Tetrahydro-6-methyl-4H-pyrido(1,2-a)pyrimidin-4-one
CID 208417
2,3-Di(propan-2-yl)pyrimidin-4-one
CID 23401236
2-[(4-Methyl-1-piperazinyl)methyl]-4(3h)-pyrimidinone
CID 67216931
2-[(3R)-4-ethyl-3-methylpiperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one
CID 89739785
7-(4-Methylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one
CID 89739845
2-[(3S)-4-ethyl-3-methylpiperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one
CID 89740912
7-(4-Ethylpiperazin-1-yl)pyrido[1,2-a]pyrimidin-4-one
CID 89740982
Ethane;2-ethyl-3-methylpyrimidin-4-one
CID 91580005
2-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one
CID 117774438
2-[(3S)-3,4-dimethylpiperazin-1-yl]pyrido[1,2-a]pyrimidin-4-one
CID 117774891
N-methyl-N-[2-(2-methyl-4-oxopyrimidin-1-yl)ethyl]acetamide
CID 130451917
3-(1,2-Dimethylpiperidin-4-yl)-2-methylpyrimidin-4-one
CID 134211371

Frequently Asked Questions

What is the IUPAC name of 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one?
The IUPAC name of 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one (CID 153405165) is 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one.
What is the SMILES notation for 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one?
The canonical SMILES for 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one is CCC(C)N1CCn2c(nccc2=O)C1.
What is the InChIKey of 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one?
The InChIKey is UCLMJPWIQPTZFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-3-9(2)13-6-7-14-10(8-13)12-5-4-11(14)15/h4-5,9H,3,6-8H2,1-2H3.
What are the key properties of 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one?
8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one has a molecular weight of 207.28 g/mol, XLogP of 0.86, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 8-butan-2-yl-7,9-dihydro-6H-pyrazino[1,2-a]pyrimidin-4-one is sourced from PubChem (CID 153405165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).